7-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one

Systemtic Name: 7-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Openeye Name: 7-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one CAS Name: 7-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]-2,3-dihydro-1H-cyclopenta[c][1]benzopyran-4-one IUPAC Name: 7-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Traditional Name: 7-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)-2,3-dihydro-1H-cyclopenta[c]chromen-4-one Formula: C22H20N2O7S MolecularWeight: 456.4684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC4=C(C=C3)C5=C(CCC5)C(=O)O4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)OC3=CC4=C(C=C3)C5=C(CCC5)C(=O)O4)[N+](=O)[O-]

InChI

InChI=1S/C22H20N2O7S/c25-22-18-5-3-4-16(18)17-8-6-14(12-21(17)31-22)30-20-9-7-15(13-19(20)24(26)27)32(28,29)23-10-1-2-11-23/h6-9,12-13H,1-5,10-11H2